Vitas-M small molecule compound

3-(1,3-dioxooctahydro-2H-isoindol-2-yl)phenyl 4-methylbenzoate

Catalog ID
STK275032
SMILES Cc1ccc(cc1)C(=O)Oc1cccc(c1)N1C(=O)C2C(C1=O)CCCC2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H21NO4 MW 363.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO4/c1-14-9-11-15(12-10-14)22(26)27-17-6-4-5-16(13-17)23-20(24)18-7-2-3-8-19(18)21(23)25/h4-6,9-13,18-19H,2-3,7-8H2,1H3
InChIKey
DHUONFGEZUEDGK-UHFFFAOYSA-N
Synonyms

(3(13dioxo3a45677ahexahydroisoindol2yl)phenyl)4methylbenzoate
3((3AR7AR)13DIOXOOCTAHYDRO2HISOINDOL2YL)PHENYL4METHYLBENZOATE
3((3AR7AS)13DIOXOOCTAHYDRO2HISOINDOL2YL)PHENYL4METHYLBENZOATE
3(13dioxooctahydro2Hisoindol2yl)phenyl4methylbenzoate
CC1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)N3C(=O)C4CCCCC4C3=O
InChI=1SC22H21NO4c11491115(121014)22(26)271764516(1317)2320(24)18723819(18)21(23)25h469131819H2378H21H3
MFCD03187037
ZINC000017987546
ZINC000100839104

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Available files

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